1,4,4a,9a-Tetrahydroanthraquinone
TL;DR: 1,4,4a,9a-Tetrahydroanthraquinone (CAS 56136-14-2) is a chemical compound with molecular formula C14H12O2 and molecular weight 212.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4,4a,9a-tetrahydroanthracene-9,10-dione
Also Known As: 1,4,4a,9a-Tetrahydroanthraquinone, 2-Methoxyneuraminic acid, 1,4,4a,9a-Tetrahydro-9,10-anthracenedione, 9,10-Anthracenedione, 1,4,4a,9a-tetrahydro-, 1,4,4a,9a-tetrahydroanthracene-9,10-dione
| Molecular Formula | C14H12O2 |
|---|---|
| Molecular Weight | 212.08 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 212.08372 |
| Heavy Atoms | 16 |
| Complexity | 322.0 |
Chemical Identifiers
| CAS Number | 56136-14-2 |
|---|---|
| SMILES | C1C=CCC2C1C(=O)C3=CC=CC=C3C2=O |
| InChIKey | XPCZSIPRUSOJFO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4,4a,9a-Tetrahydroanthraquinone (CAS 56136-14-2), with molecular formula C14H12O2 and molecular weight 212.08 g/mol. IUPAC: 1,4,4a,9a-tetrahydroanthracene-9,10-dione.
Chemical Property Profile of 1,4,4a,9a-Tetrahydroanthraquinone
Property Insights of 1,4,4a,9a-Tetrahydroanthraquinone
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4,4a,9a-Tetrahydroanthraquinone. With a topological polar surface area (TPSA) of 34.1 Ų, 1,4,4a,9a-Tetrahydroanthraquinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4,4a,9a-Tetrahydroanthraquinone has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,4,4a,9a-Tetrahydroanthraquinone?
The CAS number of 1,4,4a,9a-Tetrahydroanthraquinone is 56136-14-2.
What is the molecular formula of 1,4,4a,9a-Tetrahydroanthraquinone?
The molecular formula of 1,4,4a,9a-Tetrahydroanthraquinone is C14H12O2.
What is the molecular weight of 1,4,4a,9a-Tetrahydroanthraquinone?
The molecular weight of 1,4,4a,9a-Tetrahydroanthraquinone is 212.08 g/mol.
Where can I buy 1,4,4a,9a-Tetrahydroanthraquinone?
You can request a quote for 1,4,4a,9a-Tetrahydroanthraquinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4,4a,9a-Tetrahydroanthraquinone?
Yes, KEHONG BIO provides custom synthesis services for 1,4,4a,9a-Tetrahydroanthraquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.